Basic information
- CAS
3052150-39-4- Standard SMILES
CCCC1CCC(C2CCC(c3ccc(OC)cc3)CC2)CC1- InChIKey
YGBCZZWUEAKAFO-UHFFFAOYSA-N- Molecular formula
- C22H34O
- Average molar mass
- 314.5 g/mol
- Monoisotopic mass
- 314.2609657
Names & identifiers
- Preferred name
- (trans,trans)-4-(4-Methoxyphenyl)-4'-propyl-1,1'-bi(cyclohexane)
- IUPAC
- 1-methoxy-4-[4-(4-propylcyclohexyl)cyclohexyl]benzene
Names & synonyms
84655-98-1(trans,trans)-4-(4-Methoxyphenyl)-4'-propyl-1,1'-bi(cyclohexane)4-(4-Methoxyphenyl)-4'-propyl-1,1'-bi(cyclohexane)trans-4-(4-Methoxyphenyl)-4'-propyl-1,1'-bi(cyclohexane)152187-18-33bcHMeOPBenzene, 1-methoxy-4-(4'-propyl[1,1'-bicyclohexyl]-4-yl)-(1r,1's,4r,4'r)-4-(4-methoxyphenyl)-4'-propyl-1,1'-bi(cyclohexane)SCHEMBL7903735SCHEMBL8045452SCHEMBL8045462DTXSID901381307
Show more names
MFCD34601906AS-96592F713611-methoxy-4-(4a(2)-propyl[1,1a(2)-bicyclohexyl]-4-yl)-Benzene3052150-39-4
Database identifiers
- CAS
3052150-39-4- PubChem CID
- 584331
- DTXSID
DTXSID901381307- Nikkaji
- J1.629.872G、J2.114.764H
Properties
Computed structural properties
- XLogP
- 8.2
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 315
Experimental & physicochemical properties
Chemical ClassesLiquid Crystal (LCM) Monomers
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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